tert-butyl 4-(5-chloranyl-1H-pyrrolo[2,3-b]pyridin-4-yl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(5-chloranyl-1H-pyrrolo[2,3-b]pyridin-4-yl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-(5-chloro-1H-pyrrolo[2,3-b]pyridin-4-yl)piperazine-1-carboxylate CAS Name: 4-(5-chloro-1H-pyrrolo[2,3-b]pyridin-4-yl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(5-chloro-1H-pyrrolo[2,3-b]pyridin-4-yl)piperazine-1-carboxylate Traditional Name: 4-(5-chloro-1H-pyrrolo[2,3-b]pyridin-4-yl)piperazine-1-carboxylic acid tert-butyl ester Formula: C16H21ClN4O2 MolecularWeight: 336.81654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=C3C=CNC3=NC=C2Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=C3C=CNC3=NC=C2Cl

InChI

InChI=1S/C16H21ClN4O2/c1-16(2,3)23-15(22)21-8-6-20(7-9-21)13-11-4-5-18-14(11)19-10-12(13)17/h4-5,10H,6-9H2,1-3H3,(H,18,19)